SCHEMBL30399294

SCHEMBL30399294

CN1CCN(c2ccc(-c3cnc4[nH]cc(-c5ccnc(N6CCN(C)CC6)c5)c4c3)cn2)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 6/20 0.73
IL2 P60568 4/20 0.73
MAP3K11 Q16584 5/20 0.56
TDO2 P48775 1/20 0.55
TNIK Q9UKE5 8/20 0.52
DYRK1A Q13627 2/20 0.49
CLK2 P49760 1/20 0.49
CLK3 P49761 1/20 0.49
SGK1 O00141 1/20 0.49
IKBKB O14920 1/20 0.49
AURKA O14965 1/20 0.49
CHUK O15111 1/20 0.49
PRKAB2 O43741 1/20 0.49
ROCK2 O75116 1/20 0.49
ABL1 P00519 1/20 0.49
NTRK1 P04629 1/20 0.49
INSR P06213 1/20 0.49
LCK P06239 1/20 0.49
CDK1 P06493 1/20 0.49
IGF1R P08069 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL26175624 1.00 MAP4K1 (0.73) MAP4K1IL2MAP3K11TDO2TNIK
SCHEMBL26175663 0.93 MAP4K1 (0.63) MAP4K1IL2MAP3K11TNIKDYRK1A
SCHEMBL26175268 0.89 TNIK (0.62) MAP4K1IL2TNIK
SCHEMBL26175472 0.89 IL2 (0.59) MAP4K1IL2TNIKDYRK1ACLK2
SCHEMBL26175671 0.88 MAP4K1 (0.58) MAP4K1IL2MAP3K11TNIKDYRK1A
SCHEMBL26175356 0.88 IL2 (0.57) MAP4K1IL2TNIKLRRK2
SCHEMBL26175630 0.88 MAP4K1 (0.71) MAP4K1IL2MAP3K11TDO2TNIK
SCHEMBL26175587 0.86 MAP4K1 (0.55) MAP4K1IL2MAP3K11TDO2TNIK
SCHEMBL30399315 0.86 MAP4K1 (0.55) MAP4K1IL2MAP3K11TDO2TNIK
SCHEMBL26174757 0.86 MAP4K1 (0.54) MAP4K1IL2MAP3K11TDO2TNIK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4415817-A1 1H-PYRROLO[2,3-B]PYRIDINES AS DYRK1A INHIBITORS BioSplice Therapeutics, Inc. (US) 2024-08-21 EP claimed
WO-2023064349-A1 1H-PYRROLO[2,3-B]PYRIDINES AS DYRK1A INHIBITORS BIOSPLICE THERAPEUTICS, INC. (US) 2023-04-20 WO claimed